Methyl 2-Acetoxy-3-chloropropanoate - CAS 78626-45-6
Catalog: |
BB036213 |
Product Name: |
Methyl 2-Acetoxy-3-chloropropanoate |
CAS: |
78626-45-6 |
Synonyms: |
2-acetyloxy-3-chloropropanoic acid methyl ester; methyl 2-acetyloxy-3-chloropropanoate |
IUPAC Name: | methyl 2-acetyloxy-3-chloropropanoate |
Description: | Methyl 2-Acetoxy-3-chloropropanoate (CAS# 78626-45-6 ) is a useful research chemical. |
Molecular Weight: | 180.59 |
Molecular Formula: | C6H9ClO4 |
Canonical SMILES: | CC(=O)OC(CCl)C(=O)OC |
InChI: | InChI=1S/C6H9ClO4/c1-4(8)11-5(3-7)6(9)10-2/h5H,3H2,1-2H3 |
InChI Key: | UBLCJZKDINZZAY-UHFFFAOYSA-N |
LogP: | 0.32990 |
Publication Number | Title | Priority Date |
HU-176314-B | Process for preparing 2-acyloxy-acrylic acid esters | 19770526 |
Complexity: | 157 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 180.0189365 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 180.0189365 |
Rotatable Bond Count: | 5 |
Topological Polar Surface Area: | 52.6 |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.7 |
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